SCHEMBL5321709

SCHEMBL5321709

CCc1ccc(CSc2ccc([N+](=O)[O-])cn2)cc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.57
▸ MAPT P10636 6/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ KDM4E B2RXH2 2/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.47
▸ RAB9A P51151 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5321454 0.87 MAPT (0.57) TDP1MAPTALDH1A1SMN1; SMN2MEN1
SCHEMBL11710551 0.86 KDM4E (0.57) TDP1MAPTALDH1A1SMN1; SMN2MEN1
SCHEMBL29900467 0.86 KDM4E (0.57) TDP1MAPTALDH1A1SMN1; SMN2MEN1
SCHEMBL5320690 0.86 MAPT (0.60) TDP1MAPTALDH1A1SMN1; SMN2MEN1
SCHEMBL2204262 0.84 TDP1 (0.54) TDP1MAPTALDH1A1SMN1; SMN2MEN1
SCHEMBL1492578 0.82 KDM4E (0.55) TDP1MAPTALDH1A1SMN1; SMN2POLB
SCHEMBL5326091 0.80 MAPT (0.57) TDP1MAPTALDH1A1SMN1; SMN2MEN1
SCHEMBL5658063 0.78 MAPT (0.61) TDP1MAPTALDH1A1SMN1; SMN2POLB
SCHEMBL18786142 0.76 ALDH1A1 (0.54) TDP1MAPTALDH1A1SMN1; SMN2POLB
SCHEMBL128402 0.76 LOXL2 (0.61) MAPTALDH1A1SMN1; SMN2MEN1POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007091140-A1 SUBSTITUTED PHENYLSULFAMOYL COMPOUNDS AS PPAR AGONISTS PFIZER PRODUCTS INC. (US) 2007-08-16 — — WO disclosed
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